6G0C
Crystal structure of SdeA catalytic core
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06DA |
| Synchrotron site | SLS |
| Beamline | X06DA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-07-26 |
| Detector | DECTRIS PILATUS 2M |
| Wavelength(s) | 1.00 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 70.721, 80.824, 86.518 |
| Unit cell angles | 90.00, 110.57, 90.00 |
Refinement procedure
| Resolution | 44.216 - 2.802 |
| R-factor | 0.2597 |
| Rwork | 0.258 |
| R-free | 0.29320 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | It was solved by MR on a crude model from experimental phasing experiment (data not deposited) |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.505 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHENIX |
| Refinement software | PHENIX ((1.12_2829: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 44.216 | 2.902 |
| High resolution limit [Å] | 2.802 | 2.802 |
| Rmerge | 0.139 | |
| Number of reflections | 43693 | |
| <I/σ(I)> | 13.03 | |
| Completeness [%] | 99.6 | |
| Redundancy | 6.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 7 | 300 | 100mM Bis Tris Propane pH 7.0-8.0, 0.1-0.2M sodium citrate tribasic dihydrate, 20-30% PEG 3350 |
